N-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide

C16H28N4O4 — CID 171722453

IUPACN-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide
SMILESO=C(NC1CCCC(NC(=O)N2CCOCC2)C1)N1CCOCC1
InChIInChI=1S/C16H28N4O4/c21-15(19-4-8-23-9-5-19)17-13-2-1-3-14(12-13)18-16(22)20-6-10-24-11-7-20/h13-14H,1-12H2,(H,17,21)(H,18,22)
InChIKeyCGHFYOAMNLJVPB-UHFFFAOYSA-N
MW340.42 g/mol
LogP0.38
Rot. Bonds2

About N-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide

N-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide (PubChem CID 171722453) has the molecular formula C16H28N4O4 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide
PubChem CID171722453
Molecular FormulaC16H28N4O4
Molecular Weight340.42 g/mol
Exact Mass340.21
IUPAC NameN-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide
SMILESO=C(NC1CCCC(NC(=O)N2CCOCC2)C1)N1CCOCC1
InChIInChI=1S/C16H28N4O4/c21-15(19-4-8-23-9-5-19)17-13-2-1-3-14(12-13)18-16(22)20-6-10-24-11-7-20/h13-14H,1-12H2,(H,17,21)(H,18,22)
InChIKeyCGHFYOAMNLJVPB-UHFFFAOYSA-N
XLogP0.38
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-1,4-oxazepane-4-carboxamide
CID 115597922
N-(thian-3-yl)morpholine-4-carboxamide
CID 115675063
N-cyclopent-3-en-1-ylmorpholine-4-carboxamide
CID 115695442
N-piperidin-4-ylmorpholine-4-carboxamide;hydrochloride
CID 53255683
N-(2-methylcyclopentyl)morpholine-4-carboxamide
CID 115613523
N-(4-ethylcyclohexyl)morpholine-4-carboxamide
CID 115589164
N-[(1R,2S)-2-cyclobutylcyclopropyl]-1,4-oxazepane-4-carboxamide
CID 128909370
N-[1-(cyclopropanecarbonyl)pyrrolidin-3-yl]morpholine-4-carboxamide
CID 110871493
N-[1-(4-methylpiperidine-1-carbonyl)piperidin-4-yl]morpholine-4-carboxamide
CID 126821611
N-(1,2,3,4-tetrahydronaphthalen-2-yl)morpholine-4-carboxamide
CID 115599477
N-(9-benzyl-9-azabicyclo[3.3.1]nonan-3-yl)morpholine-4-carboxamide
CID 3741735
N-cycloheptylpiperidine-1-carboxamide
CID 54054704

Frequently Asked Questions

What is the IUPAC name of N-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide?
The IUPAC name of N-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide (CID 171722453) is N-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide.
What is the SMILES notation for N-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide?
The canonical SMILES for N-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide is O=C(NC1CCCC(NC(=O)N2CCOCC2)C1)N1CCOCC1.
What is the InChIKey of N-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide?
The InChIKey is CGHFYOAMNLJVPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O4/c21-15(19-4-8-23-9-5-19)17-13-2-1-3-14(12-13)18-16(22)20-6-10-24-11-7-20/h13-14H,1-12H2,(H,17,21)(H,18,22).
What are the key properties of N-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide?
N-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide has a molecular weight of 340.42 g/mol, XLogP of 0.38, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(morpholine-4-carbonylamino)cyclohexyl]morpholine-4-carboxamide is sourced from PubChem (CID 171722453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).